%chk=000053497.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053497

0 1
 O    5.569800       1.706500      -1.460900    
 O    3.820800     -0.2197000      0.8256000    
 N  -0.7491000     -0.6705000      8.3300002E-02
 C    5.520200       1.147300     -0.1563000    
 C    4.699800       2.333200     -0.5096000    
 C    4.871300     -0.2202000     -0.1345000    
 C    1.449900     -0.5293000      0.4322000    
 C   0.4033000      -1.418000      0.1763000    
 C  -0.4679000      0.6561000      0.2707000    
 C    2.754900      -1.041500      0.5742000    
 C   0.8853000      0.7756000      0.4891000    
 C   -2.022500      -1.197600     -0.1674000    
 C   0.5973000      -2.798600      5.5100001E-02
 C   -1.466700       1.704000      0.2335000    
 C    2.964000      -2.420300      0.4553000    
 C    1.900300      -3.283400      0.1998000    
 C   -2.820200      -1.582900      0.8987000    
 C   -2.461900      -1.320400      -1.476200    
 C   -1.763300       2.333900     -0.9721000    
 C   -2.124100       2.076300       1.402900    
 C   -4.089500      -2.104700      0.6495000    
 C   -3.731300      -1.842100      -1.725200    
 C   -2.724500       3.344000      -1.008700    
 C   -3.085400       3.086300       1.366300    
 C   -4.545100      -2.234200     -0.6623000    
 C   -3.385600       3.720100      0.1605000    
 H    6.363100       1.262500      0.5082000    
 H    3.634900       2.219600     -0.6621000    
 H    4.999600       3.297600     -0.1204000    
 H    5.619100     -0.9677000      0.1525000    
 H    4.491600     -0.4760000      -1.132800    
 H    1.417000       1.700100      0.6721000    
 H  -0.2238000      -3.479400     -0.1432000    
 H    3.961900      -2.836600      0.5697000    
 H    2.085000      -4.351200      0.1132000    
 H   -2.476500      -1.486300       1.925200    
 H   -1.837200      -1.018000      -2.312500    
 H   -1.256700       2.051700      -1.891800    
 H   -1.901200       1.591500       2.350300    
 H   -4.723300      -2.409600       1.477100    
 H   -4.086300      -1.942800      -2.746600    
 H   -2.958500       3.837300      -1.947500    
 H   -3.600400       3.379100       2.276600    
 H   -5.533600      -2.640300     -0.8563000    
 H   -4.134200       4.506400      0.1321000    


%chk=000053497-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000053497

0 1
O 7.274783 1.005645 -0.288450
O 3.601877 0.302818 0.062385
N -0.980909 -0.629563 0.153252
C 5.818461 1.194251 0.069973
C 6.340728 1.759682 -1.212044
C 5.019661 -0.089798 0.088071
C 1.290633 -0.314157 0.115632
C 0.258549 -1.307922 0.177843
C -0.731641 0.772290 0.064395
C 2.650660 -0.732118 0.119616
C 0.653790 0.972872 0.042612
C -2.251250 -1.290999 0.019824
C 0.541917 -2.694228 0.204410
C -1.781826 1.808290 0.093143
C 2.952144 -2.108453 0.165961
C 1.897924 -3.069059 0.200248
C -2.653551 -2.243194 0.988542
C -3.090568 -1.005112 -1.084934
C -1.590877 3.006986 -0.652071
C -2.961758 1.684483 0.880601
C -3.892900 -2.906227 0.849257
C -4.333730 -1.661344 -1.209517
C -2.543108 4.046228 -0.610115
C -3.917294 2.721951 0.913662
C -4.738657 -2.615699 -0.246706
C -3.715544 3.908152 0.170007
H 5.647081 1.872926 0.914717
H 6.113429 1.245125 -2.153923
H 6.537568 2.835499 -1.285829
H 5.235831 -0.670142 1.008220
H 5.270420 -0.712554 -0.794123
H 1.151286 1.939660 0.045115
H -0.251252 -3.446213 0.219543
H 3.987286 -2.461780 0.166116
H 2.159450 -4.132738 0.223376
H -2.006418 -2.442871 1.849070
H -2.765556 -0.275423 -1.832873
H -0.696856 3.108598 -1.277491
H -3.123103 0.784954 1.482808
H -4.200572 -3.640637 1.601800
H -4.981552 -1.433047 -2.062830
H -2.376083 4.958668 -1.193673
H -4.816884 2.606605 1.528658
H -5.702073 -3.126782 -0.349091
H -4.459217 4.712181 0.198411


